3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one

C8H7N3OS — CID 118139886

IUPAC3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one
SMILESNc1cccn(-c2nccs2)c1=O
InChIInChI=1S/C8H7N3OS/c9-6-2-1-4-11(7(6)12)8-10-3-5-13-8/h1-5H,9H2
InChIKeyACINQVCCJJNEJQ-UHFFFAOYSA-N
MW193.23 g/mol
LogP0.88
Rot. Bonds1

About 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one

3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one (PubChem CID 118139886) has the molecular formula C8H7N3OS and a molecular weight of 193.23 g/mol. Its IUPAC name is 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one
PubChem CID118139886
Molecular FormulaC8H7N3OS
Molecular Weight193.23 g/mol
Exact Mass193.03
IUPAC Name3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one
SMILESNc1cccn(-c2nccs2)c1=O
InChIInChI=1S/C8H7N3OS/c9-6-2-1-4-11(7(6)12)8-10-3-5-13-8/h1-5H,9H2
InChIKeyACINQVCCJJNEJQ-UHFFFAOYSA-N
XLogP0.88
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one?
The IUPAC name of 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one (CID 118139886) is 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one?
The canonical SMILES for 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one is Nc1cccn(-c2nccs2)c1=O.
What is the InChIKey of 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one?
The InChIKey is ACINQVCCJJNEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3OS/c9-6-2-1-4-11(7(6)12)8-10-3-5-13-8/h1-5H,9H2.
What are the key properties of 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one?
3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one has a molecular weight of 193.23 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(1,3-thiazol-2-yl)pyridin-2-one is sourced from PubChem (CID 118139886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).